SCHEMBL4507130

SCHEMBL4507130

C/C(=C/C(=O)N1CCOCC1)c1ccc2oc(C(=O)c3ccccc3)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.49
NPC1 O15118 6/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TSHR P16473 2/20 0.49
MAPK1 P28482 2/20 0.49
HPGD P15428 3/20 0.47
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
MAPT P10636 3/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4507132 1.00 RAB9A (0.49) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4507125 1.00 RAB9A (0.49) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4517999 0.88 RAB9A (0.51) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4518006 0.88 RAB9A (0.51) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4518007 0.88 RAB9A (0.51) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4508465 0.87 RAB9A (0.48) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4508463 0.87 RAB9A (0.48) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4508461 0.87 RAB9A (0.48) RAB9ANPC1MEN1KMT2ATSHR
SCHEMBL4497929 0.73 RAB9A (0.38) RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL4493133 0.72 RAB9A (0.40) RAB9ANPC1MEN1KMT2ATSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R RAB9A 4698/4885NPC1 1377/4885MEN1 3723/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.